CID 41691

2,2'-biphenyldiglyoxylaldehyde

Structural Information

Molecular Formula
C16H10O4
SMILES
C1=CC=C(C(=C1)C2=CC=CC=C2C(=O)C=O)C(=O)C=O
InChI
InChI=1S/C16H10O4/c17-9-15(19)13-7-3-1-5-11(13)12-6-2-4-8-14(12)16(20)10-18/h1-10H
InChIKey
SPFQACGIOCIVKU-UHFFFAOYSA-N
Compound name
2-[2-(2-oxaldehydoylphenyl)phenyl]-2-oxoacetaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

266.05792 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 267.06520 156.1
[M+Na]+ 289.04714 164.0
[M-H]- 265.05064 163.2
[M+NH4]+ 284.09174 172.1
[M+K]+ 305.02108 160.7
[M+H-H2O]+ 249.05518 148.6
[M+HCOO]- 311.05612 179.5
[M+CH3COO]- 325.07177 197.0
[M+Na-2H]- 287.03259 159.5
[M]+ 266.05737 158.4
[M]- 266.05847 158.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.